Molecule

ID:52211

General Information

Structure

MolImage

Molecular Formula

C₁₀H₂₂N₄O₂

Molecular Mass

230.30728

Exact Mass

230.17427596

Charge

0

InChI

InChI=1S/C10H22N4O2/c11-13-9(15)7-5-3-1-2-4-6-8-10(16)14-12/h1-8,11-12H2,(H,13,15)(H,14,16)

InChIKey

ZWLIYXJBOIDXLL-UHFFFAOYSA-N

Canonic Smiles

NNC(=O)CCCCCCCCC(=O)NN

Isomeric Smiles

C(=O)(CCCCCCCCC(=O)NN)NN

Calculated Properties

JChem

Acid pKa

13.120573

H Acceptors

4

H Donor

4

LogD (pH = 5.5)

0.056985553

LogD (pH = 7.4)

0.062027156

Log P

0.06209241

Molar Refractivity

63.7556

Polarizability

24.442905

Polar Surface Area

110.24

Rotatable Bonds

9

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

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Molecular Spectra

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Molecule Details

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References

Bioactivity